![4-[(E)-2-Phenylethenyl]-2-pyrimidinylamine](/api/spectrum/18iYUINPeiP/structure.png?h=300&w=458 "4-[(E)-2-Phenylethenyl]-2-pyrimidinylamine")
| SpectraBase Compound ID | 89ZiN4RiNv8 |
|---|---|
| InChI | InChI=1S/C12H11N3/c13-12-14-9-8-11(15-12)7-6-10-4-2-1-3-5-10/h1-9H,(H2,13,14,15)/b7-6+ |
| InChIKey | LNUXNUNUGIHCPA-VOTSOKGWSA-N |
| Mol Weight | 197.24 g/mol |
| Molecular Formula | C12H11N3 |
| Exact Mass | 197.095297 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 18iYUINPeiP |
|---|---|
| Name | 4-[(E)-2-Phenylethenyl]-2-pyrimidinylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.095297366 u |
| Formula | C12H11N3 |
| InChI | InChI=1S/C12H11N3/c13-12-14-9-8-11(15-12)7-6-10-4-2-1-3-5-10/h1-9H,(H2,13,14,15)/b7-6+ |
| InChIKey | LNUXNUNUGIHCPA-VOTSOKGWSA-N |
| Molecular Weight | 197.241 g/mol |
| SMILES | C1(N)=NC(=CC=N1)\C=C\C1=CC=CC=C1 |